Home Other Building Blocks 2,2-Dimethyl-1-(thiophen-2-yl)propan-1-one

2,2-Dimethyl-1-(thiophen-2-yl)propan-1-one

CAS No.:
20409-48-7
Catalog Number:
AG003F61
Molecular Formula:
C9H12OS
Molecular Weight:
168.2560
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Product Description
Catalog Number:
AG003F61
Chemical Name:
2,2-Dimethyl-1-(thiophen-2-yl)propan-1-one
CAS Number:
20409-48-7
Molecular Formula:
C9H12OS
Molecular Weight:
168.2560
MDL Number:
MFCD00054601
IUPAC Name:
2,2-dimethyl-1-thiophen-2-ylpropan-1-one
InChI:
InChI=1S/C9H12OS/c1-9(2,3)8(10)7-5-4-6-11-7/h4-6H,1-3H3
InChI Key:
PMUOKYKJIKZPIR-UHFFFAOYSA-N
SMILES:
O=C(C(C)(C)C)c1cccs1
Properties
Complexity:
157  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
168.061g/mol
Formal Charge:
0
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
168.254g/mol
Monoisotopic Mass:
168.061g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
45.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.7  
Properties